SCHEMBL10072088

SCHEMBL10072088

C=C1OB(c2ccc(C(F)(F)F)cc2Cl)OC1(C)C

nearest known ligand 0.36

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ PDE2A O00408 4/20 0.36
▸ ALDH1A1 P00352 1/20 0.30
▸ MAPT P10636 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL10072089 0.86 NOTUM (0.32) PDE2AMAPT
SCHEMBL12565130 0.81 MEN1 (0.33) —
SCHEMBL837116 0.80 PDE2A (0.41) PDE2AALDH1A1MAPT
SCHEMBL13268220 0.77 CFTR (0.45) ALDH1A1MAPT
SCHEMBL13080948 0.77 LPL (0.33) —
SCHEMBL14792949 0.75 TSHR (0.34) —
SCHEMBL13118388 0.73 KIF11 (0.34) ALDH1A1
SCHEMBL12920534 0.71 PTGDR2 (0.36) MAPT
SCHEMBL12565133 0.70 PPARD (0.44) ALDH1A1MAPT
SCHEMBL22366955 0.70 LIPE (0.34) PDE2A

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8143068-B2 Oxidation resistant indicator molecules SENSORS FOR MEDICINE AND SCIENCE, INC. (US) 2012-03-27 — — US disclosed
US-20110081727-A1 Oxidation Resistant Indicator Molecules SENSORS FOR MEDICINE AND SCIENCE, INC. (US) 2011-04-07 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20110081727-A1 Oxidation Resistant Indicator Molecules AOX1, GPX4, SQOR PDE2A 4157/4885ALDH1A1 129/4885MAPT 4290/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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